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233153

Sigma-Aldrich

2′-(Trifluoromethyl)acetophenone

99%

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About This Item

Linear Formula:
CF3C6H4COCH3
CAS Number:
Molecular Weight:
188.15
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

99%

form

liquid

refractive index

n20/D 1.4584 (lit.)

density

1.255 g/mL at 25 °C (lit.)

functional group

fluoro
ketone

storage temp.

2-8°C

SMILES string

CC(=O)c1ccccc1C(F)(F)F

InChI

1S/C9H7F3O/c1-6(13)7-4-2-3-5-8(7)9(10,11)12/h2-5H,1H3

InChI key

FYDUUODXZQITBF-UHFFFAOYSA-N

Related Categories

Application

2′-(Trifluoromethyl)acetophenone has been used to investigate the use of in situ generated CuCF3 for the direct substitution of chlorine by CF3 in various aromatic substrates.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

183.2 °F - closed cup

Flash Point(C)

84 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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The trifluoromethylation of chloroaromatics using the copper-CF2Br2-dialkylamide reaction system.
Clark JH, et al.
Journal of Fluorine Chemistry, 50(3), 411-426 (1990)

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